#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ftt n ARG 1 N 0.00 0.46 -4.64 0.03 1.74 -0.56 -4.90 116.66 108.79 1ftt n ARG 1 Ca 0.00 0.00 -0.29 0.00 -0.77 0.00 0.00 57.85 56.79 1ftt n ARG 1 Cb 0.00 0.00 -0.09 0.00 -1.02 0.00 0.00 32.46 31.35 1ftt n ARG 1 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 1ftt s ARG 2 N 1.64 2.02 0.00 5.56 1.81 -1.26 -0.45 118.95 128.28 1ftt s ARG 2 Ca 0.00 -2.23 0.00 0.00 -1.72 0.00 0.00 55.73 51.78 1ftt s ARG 2 Cb 0.00 -1.28 0.00 0.00 -0.45 0.00 0.00 34.95 33.22 1ftt s ARG 2 CO 0.00 -0.30 0.00 1.63 -0.68 0.00 0.00 175.30 175.95 1ftt n LYS 3 N -1.06 0.00 0.00 3.54 4.01 -1.26 -4.23 118.16 119.16 1ftt n LYS 3 Ca -0.11 0.00 0.00 0.00 -0.51 0.00 0.00 58.31 57.69 1ftt n LYS 3 Cb 0.67 0.00 0.00 0.00 -0.51 0.00 0.00 35.03 35.19 1ftt n LYS 3 CO 0.00 0.00 0.00 -2.13 -1.11 0.00 0.00 177.40 174.16 1ftt n ARG 4 N 0.00 0.00 -2.86 1.97 0.63 -1.26 -4.51 116.66 110.63 1ftt n ARG 4 Ca 0.00 0.00 -0.44 0.00 -0.92 0.00 0.00 57.85 56.49 1ftt n ARG 4 Cb 0.00 -0.33 -0.00 0.00 0.45 0.00 0.00 32.46 32.58 1ftt n ARG 4 CO 0.00 0.00 0.00 -0.98 -2.51 0.00 0.00 177.63 174.14 1ftt s ARG 5 N -0.02 4.04 0.07 -0.14 1.70 -1.26 -4.99 118.95 118.34 1ftt s ARG 5 Ca 0.00 -2.40 -0.31 0.00 -0.47 0.00 0.00 55.73 52.56 1ftt s ARG 5 Cb 0.00 -5.16 -0.08 0.00 -0.57 0.00 0.00 34.95 29.14 1ftt s ARG 5 CO 0.00 -1.88 1.59 0.08 -1.08 0.00 0.00 175.30 174.01 1ftt s VAL 6 N 2.25 3.14 -1.10 4.99 1.01 -1.26 -1.50 120.40 127.93 1ftt s VAL 6 Ca 0.45 0.62 -0.22 0.00 0.00 0.00 0.00 61.98 62.83 1ftt s VAL 6 Cb -0.01 -3.40 0.05 0.00 0.00 0.00 0.00 36.38 33.02 1ftt s VAL 6 CO 0.01 0.00 1.55 -0.22 0.00 0.00 0.00 175.10 176.45 1ftt s LEU 7 N 2.39 3.58 0.46 3.92 2.96 0.40 -4.84 118.68 127.56 1ftt s LEU 7 Ca 0.71 -1.72 0.00 0.00 -0.22 0.00 0.00 54.13 52.90 1ftt s LEU 7 Cb -0.38 -2.57 0.00 0.00 0.50 0.00 0.00 46.19 43.73 1ftt s LEU 7 CO 0.31 -1.46 0.00 0.49 -1.32 0.00 0.00 176.35 174.37 1ftt n PHE 8 N 8.94 -3.00 -2.66 5.38 3.72 -1.26 -4.96 117.46 123.62 1ftt n PHE 8 Ca 0.38 1.65 -0.22 0.00 -0.05 0.00 0.00 57.45 59.20 1ftt n PHE 8 Cb 0.49 -2.70 0.03 0.00 -0.94 0.00 0.00 39.48 36.37 1ftt n PHE 8 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 176.76 175.17 1ftt s SER 9 N -5.97 5.38 0.15 4.37 1.04 -1.26 -4.97 113.70 112.45 1ftt s SER 9 Ca 0.00 0.16 -0.14 0.00 0.48 0.00 0.00 55.95 56.46 1ftt s SER 9 Cb 0.00 -1.12 0.02 0.00 0.10 0.00 0.00 66.02 65.02 1ftt s SER 9 CO 0.00 -1.08 1.65 1.56 0.98 0.00 0.00 173.24 176.36 1ftt h GLN 10 N 0.06 0.77 -0.21 4.02 7.50 -1.98 -2.11 115.11 123.16 1ftt h GLN 10 Ca -0.44 -0.18 -0.00 0.00 0.50 0.00 0.00 58.65 58.53 1ftt h GLN 10 Cb 1.28 -0.10 -0.01 0.00 0.05 0.00 0.00 27.48 28.70 1ftt h GLN 10 CO 0.55 0.75 0.12 0.00 -1.50 0.00 0.00 178.83 178.75 1ftt h ALA 11 N 0.99 0.27 0.36 3.87 0.00 -1.98 0.99 119.26 123.75 1ftt h ALA 11 Ca 0.15 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 55.00 1ftt h ALA 11 Cb 0.32 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.00 1ftt h ALA 11 CO 0.00 -0.20 -0.41 1.96 0.00 0.00 0.00 179.25 180.60 1ftt h GLN 12 N 0.24 -0.77 -0.03 0.00 4.20 -1.85 -2.65 115.11 114.25 1ftt h GLN 12 Ca 0.07 0.05 -0.12 0.00 0.06 0.00 0.00 58.65 58.72 1ftt h GLN 12 Cb 0.06 0.18 -0.02 0.00 0.30 0.00 0.00 27.48 28.00 1ftt h GLN 12 CO -0.01 -0.51 -0.54 0.28 -0.67 0.00 0.00 178.83 177.37 1ftt h VAL 13 N -0.80 1.38 -0.54 -0.54 2.07 -1.37 -2.15 116.25 114.30 1ftt h VAL 13 Ca -0.03 -1.85 0.10 0.00 0.82 0.00 0.00 66.70 65.74 1ftt h VAL 13 Cb 0.73 1.97 -0.08 0.00 -1.52 0.00 0.00 31.29 32.39 1ftt h VAL 13 CO -0.09 0.54 0.10 0.22 0.02 0.00 0.00 177.57 178.36 1ftt h TYR 14 N 0.06 0.16 -0.45 1.57 3.20 -0.68 0.13 116.97 120.96 1ftt h TYR 14 Ca -0.00 0.03 -0.06 0.00 3.14 0.00 0.00 58.73 61.84 1ftt h TYR 14 Cb 0.98 0.01 -0.02 0.00 1.54 0.00 0.00 36.73 39.24 1ftt h TYR 14 CO 0.01 -0.03 0.04 0.93 -1.64 0.00 0.00 178.16 177.47 1ftt h GLU 15 N 0.24 0.77 -0.00 1.82 4.39 -1.08 -0.04 114.58 120.67 1ftt h GLU 15 Ca 0.28 -0.22 0.00 0.00 0.34 0.00 0.00 59.36 59.75 1ftt h GLU 15 Cb 0.39 -0.08 -0.00 0.00 -0.10 0.00 0.00 28.75 28.96 1ftt h GLU 15 CO -0.37 0.81 0.00 -0.07 -1.16 0.00 0.00 179.01 178.22 1ftt h LEU 16 N 0.62 0.00 -0.16 1.33 3.38 -0.84 -1.39 115.31 118.26 1ftt h LEU 16 Ca 0.13 -0.01 0.03 0.00 0.09 0.00 0.00 57.88 58.12 1ftt h LEU 16 Cb 0.44 -0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.16 1ftt h LEU 16 CO 0.02 0.01 -0.00 -0.33 0.09 0.00 0.00 178.44 178.22 1ftt h GLU 17 N -0.00 0.05 -0.59 1.13 5.08 -0.74 0.31 114.58 119.82 1ftt h GLU 17 Ca 0.00 -0.00 0.11 0.00 -1.00 0.00 0.00 59.36 58.47 1ftt h GLU 17 Cb 0.01 -0.01 -0.09 0.00 0.50 0.00 0.00 28.75 29.16 1ftt h GLU 17 CO -0.00 0.03 0.11 -0.09 -1.00 0.00 0.00 179.01 178.06 1ftt h ARG 18 N 0.05 0.23 -0.23 2.33 2.43 -0.82 -0.24 114.38 118.13 1ftt h ARG 18 Ca 0.07 -0.01 -0.09 0.00 -0.81 0.00 0.00 59.98 59.14 1ftt h ARG 18 Cb 0.09 -0.05 -0.00 0.00 -0.42 0.00 0.00 29.97 29.58 1ftt h ARG 18 CO -0.12 0.15 -0.19 -0.09 -1.51 0.00 0.00 179.97 178.21 1ftt h ARG 19 N 0.24 0.54 -0.81 0.20 9.65 -1.03 -3.19 114.38 119.98 1ftt h ARG 19 Ca 0.31 -0.27 0.11 0.00 -1.10 0.00 0.00 59.98 59.03 1ftt h ARG 19 Cb 0.46 0.00 -0.08 0.00 -1.39 0.00 0.00 29.97 28.96 1ftt h ARG 19 CO -0.41 0.85 0.44 0.35 2.80 0.00 0.00 179.97 184.00 1ftt h PHE 20 N 0.24 0.79 -0.67 2.20 3.57 -0.30 -0.35 116.94 122.42 1ftt h PHE 20 Ca 0.04 0.03 0.01 0.00 3.53 0.00 0.00 57.97 61.59 1ftt h PHE 20 Cb 0.73 -0.23 -0.03 0.00 2.79 0.00 0.00 35.95 39.20 1ftt h PHE 20 CO 0.07 0.28 0.44 0.87 -2.23 0.00 0.00 178.31 177.75 1ftt h LYS 21 N 0.71 0.85 0.22 1.11 1.57 -1.06 -3.11 116.57 116.86 1ftt h LYS 21 Ca 0.41 -0.05 -0.01 0.00 -1.87 0.00 0.00 60.65 59.12 1ftt h LYS 21 Cb 0.44 -0.19 0.00 0.00 0.08 0.00 0.00 32.23 32.56 1ftt h LYS 21 CO -0.28 0.56 -0.11 0.37 -0.57 0.00 0.00 179.45 179.43 1ftt h GLN 22 N 0.88 -0.28 -2.28 3.15 4.15 -1.24 -3.48 115.11 116.00 1ftt h GLN 22 Ca 0.25 0.02 -0.06 0.00 0.77 0.00 0.00 58.65 59.63 1ftt h GLN 22 Cb -0.06 0.06 -0.22 0.00 0.21 0.00 0.00 27.48 27.47 1ftt h GLN 22 CO -0.06 0.05 -0.04 -1.14 -1.93 0.00 0.00 178.83 175.71 1ftt s GLN 23 N -3.20 0.66 -0.18 1.69 0.74 -0.25 -5.08 119.66 114.04 1ftt s GLN 23 Ca -0.10 0.89 0.00 0.00 0.05 0.00 0.00 55.36 56.20 1ftt s GLN 23 Cb 0.00 0.26 0.17 0.00 1.10 0.00 0.00 33.01 34.55 1ftt s GLN 23 CO 0.37 -0.10 1.67 1.63 -0.55 0.00 0.00 175.29 178.30 1ftt n LYS 24 N 3.20 1.46 0.00 1.67 4.76 -1.26 -3.92 118.16 124.07 1ftt n LYS 24 Ca -0.16 -0.98 0.00 0.00 -2.87 0.00 0.00 58.31 54.30 1ftt n LYS 24 Cb 0.56 -1.38 0.00 0.00 -1.84 0.00 0.00 35.03 32.37 1ftt n LYS 24 CO 0.00 0.00 0.00 0.66 -1.37 0.00 0.00 177.40 176.69 1ftt n TYR 25 N 0.39 0.00 -2.22 2.13 4.01 -1.26 -4.96 117.16 115.25 1ftt n TYR 25 Ca 0.19 0.00 -0.41 0.00 -0.16 0.00 0.00 57.90 57.52 1ftt n TYR 25 Cb 0.70 0.00 -0.03 0.00 -0.31 0.00 0.00 39.34 39.70 1ftt n TYR 25 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 1ftt s LEU 26 N 0.00 4.45 0.76 7.72 1.43 -1.26 -5.03 118.68 126.75 1ftt s LEU 26 Ca 0.00 2.50 -0.11 0.00 -1.03 0.00 0.00 54.13 55.50 1ftt s LEU 26 Cb 0.00 -3.63 0.05 0.00 0.03 0.00 0.00 46.19 42.64 1ftt s LEU 26 CO 0.00 -0.46 1.09 -0.94 0.23 0.00 0.00 176.35 176.27 1ftt s SER 27 N -0.26 4.60 0.30 2.29 1.04 -1.26 -4.59 113.70 115.82 1ftt s SER 27 Ca 0.51 1.81 0.04 0.00 0.48 0.00 0.00 55.95 58.79 1ftt s SER 27 Cb -0.37 -2.52 0.77 0.00 0.10 0.00 0.00 66.02 64.00 1ftt s SER 27 CO 0.45 -1.97 1.63 0.00 0.98 0.00 0.00 173.24 174.33 1ftt h ALA 28 N -1.05 1.33 0.18 5.32 0.00 -2.01 -0.42 119.26 122.61 1ftt h ALA 28 Ca -0.44 0.25 -0.23 0.00 0.00 0.00 0.00 54.91 54.49 1ftt h ALA 28 Cb 1.23 0.36 0.03 0.00 0.00 0.00 0.00 17.79 19.41 1ftt h ALA 28 CO 0.52 -0.52 -1.01 -1.00 0.00 0.00 0.00 179.25 177.24 1ftt h PRO 29 N 0.16 0.37 -0.35 0.00 0.13 -2.02 -3.38 132.00 126.92 1ftt h PRO 29 Ca 0.58 -0.63 -0.03 0.00 -0.87 0.00 0.00 66.00 65.05 1ftt h PRO 29 Cb 1.22 0.24 -0.02 0.00 0.13 0.00 0.00 31.00 32.57 1ftt h PRO 29 CO -0.71 1.30 0.07 1.49 -0.23 0.00 0.00 178.00 179.92 1ftt h GLU 30 N -0.22 0.51 -0.99 0.86 4.81 -1.56 -2.04 114.58 115.95 1ftt h GLU 30 Ca -0.18 -0.09 0.09 0.00 -0.13 0.00 0.00 59.36 59.06 1ftt h GLU 30 Cb 1.80 -0.09 -0.07 0.00 0.63 0.00 0.00 28.75 31.02 1ftt h GLU 30 CO 0.19 0.49 0.63 0.07 -0.73 0.00 0.00 179.01 179.66 1ftt h ARG 31 N 0.50 1.04 -0.19 1.92 0.11 -1.30 0.31 114.38 116.77 1ftt h ARG 31 Ca 0.12 -0.06 -0.10 0.00 0.10 0.00 0.00 59.98 60.04 1ftt h ARG 31 Cb 0.22 -0.23 -0.00 0.00 1.11 0.00 0.00 29.97 31.07 1ftt h ARG 31 CO -0.00 0.69 -0.27 1.49 0.10 0.00 0.00 179.97 181.98 1ftt h GLU 32 N 1.07 0.51 0.10 0.08 4.81 -1.57 -1.02 114.58 118.56 1ftt h GLU 32 Ca 0.45 -0.30 0.01 0.00 -0.13 0.00 0.00 59.36 59.39 1ftt h GLU 32 Cb 0.31 0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.70 1ftt h GLU 32 CO -0.20 0.89 -0.11 0.45 -0.73 0.00 0.00 179.01 179.31 1ftt h HIS 33 N 0.17 -0.30 0.24 0.92 3.86 -1.19 -1.41 115.15 117.43 1ftt h HIS 33 Ca 0.02 0.00 -0.00 0.00 -1.16 0.00 0.00 60.37 59.23 1ftt h HIS 33 Cb 0.84 0.12 -0.01 0.00 1.06 0.00 0.00 27.41 29.42 1ftt h HIS 33 CO 0.09 -0.18 -0.18 1.25 0.86 0.00 0.00 177.93 179.77 1ftt h LEU 34 N -0.25 -0.46 -0.25 2.43 6.46 -0.95 -1.07 115.31 121.22 1ftt h LEU 34 Ca 0.01 0.04 0.06 0.00 -0.12 0.00 0.00 57.88 57.87 1ftt h LEU 34 Cb 0.25 0.15 -0.07 0.00 -0.73 0.00 0.00 40.66 40.26 1ftt h LEU 34 CO -0.04 -0.28 -0.19 0.00 -0.62 0.00 0.00 178.44 177.31 1ftt h ALA 35 N 0.31 -0.03 -0.19 1.25 0.00 -1.06 0.14 119.26 119.67 1ftt h ALA 35 Ca -0.01 0.09 0.04 0.00 0.00 0.00 0.00 54.91 55.03 1ftt h ALA 35 Cb 0.37 0.42 -0.04 0.00 0.00 0.00 0.00 17.79 18.54 1ftt h ALA 35 CO -0.01 -0.61 -0.07 1.03 0.00 0.00 0.00 179.25 179.59 1ftt h SER 36 N -0.19 -0.24 0.36 0.00 0.87 -1.15 -3.01 113.55 110.20 1ftt h SER 36 Ca 0.14 0.07 -0.02 0.00 -1.23 0.00 0.00 61.79 60.75 1ftt h SER 36 Cb 0.40 0.15 0.00 0.00 -0.44 0.00 0.00 62.40 62.51 1ftt h SER 36 CO -0.36 -0.09 -0.17 0.24 -0.53 0.00 0.00 176.83 175.91 1ftt h MET 37 N -0.03 -0.46 0.04 2.24 2.07 -0.48 -3.39 114.93 114.91 1ftt h MET 37 Ca 0.10 0.03 -0.00 0.00 -2.07 0.00 0.00 59.70 57.76 1ftt h MET 37 Cb 0.18 0.11 0.00 0.00 -1.87 0.00 0.00 31.60 30.02 1ftt h MET 37 CO -0.22 -0.31 -0.02 -0.84 1.07 0.00 0.00 176.91 176.59 1ftt h ILE 38 N -0.82 1.14 0.00 -1.22 3.07 -0.84 -3.48 117.51 115.36 1ftt h ILE 38 Ca -0.05 -0.58 0.00 0.00 1.55 0.00 0.00 64.86 65.78 1ftt h ILE 38 Cb 0.37 1.52 0.00 0.00 -0.27 0.00 0.00 36.82 38.44 1ftt h ILE 38 CO 0.08 0.15 0.00 1.41 -1.05 0.00 0.00 178.15 178.74 1ftt n HIS 39 N -4.99 0.00 -0.73 0.16 8.25 -1.14 -4.80 115.22 111.96 1ftt n HIS 39 Ca -0.08 0.00 -0.33 0.00 -0.26 0.00 0.00 57.72 57.05 1ftt n HIS 39 Cb 0.16 0.00 0.15 0.00 1.12 0.00 0.00 29.99 31.41 1ftt n HIS 39 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 1ftt n LEU 40 N 0.00 -1.26 -4.93 2.41 7.99 -1.22 -4.83 117.00 115.17 1ftt n LEU 40 Ca 0.00 0.11 -0.27 0.00 -0.01 0.00 0.00 56.01 55.83 1ftt n LEU 40 Cb 0.00 -1.09 -0.03 0.00 -0.11 0.00 0.00 43.42 42.19 1ftt n LEU 40 CO 0.00 -3.38 0.04 0.42 -1.51 0.00 0.00 177.39 172.96 1ftt s THR 41 N -2.32 5.19 0.53 -5.08 -4.23 -1.26 -4.32 115.64 104.16 1ftt s THR 41 Ca 0.56 -0.35 0.24 0.00 -1.18 0.00 0.00 61.69 60.97 1ftt s THR 41 Cb -0.17 -3.74 0.38 0.00 1.34 0.00 0.00 72.50 70.32 1ftt s THR 41 CO 0.67 -0.19 2.01 1.55 -0.54 0.00 0.00 174.62 178.12 1ftt h PRO 42 N 1.95 0.00 0.46 3.99 0.13 -1.93 0.29 132.00 136.89 1ftt h PRO 42 Ca -0.48 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.63 1ftt h PRO 42 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 1ftt h PRO 42 CO 0.68 0.00 -0.22 1.15 -0.23 0.00 0.00 178.00 179.38 1ftt h THR 43 N 0.00 0.42 -0.86 1.56 2.02 -1.98 -1.83 112.91 112.24 1ftt h THR 43 Ca 0.22 -0.47 -0.02 0.00 0.77 0.00 0.00 66.41 66.91 1ftt h THR 43 Cb 0.90 0.59 -0.04 0.00 -1.74 0.00 0.00 68.15 67.86 1ftt h THR 43 CO -0.00 0.07 0.47 1.56 0.37 0.00 0.00 175.52 177.98 1ftt h GLN 44 N -0.94 1.21 -0.12 6.66 1.08 -1.73 0.24 115.11 121.51 1ftt h GLN 44 Ca -0.06 -0.15 0.03 0.00 -1.45 0.00 0.00 58.65 57.02 1ftt h GLN 44 Cb 0.58 -0.23 -0.06 0.00 -0.05 0.00 0.00 27.48 27.71 1ftt h GLN 44 CO 0.10 0.89 -0.52 0.28 -0.95 0.00 0.00 178.83 178.64 1ftt h VAL 45 N 1.21 0.03 -0.35 -0.54 2.07 -1.05 -0.89 116.25 116.73 1ftt h VAL 45 Ca 0.30 0.00 -0.07 0.00 0.82 0.00 0.00 66.70 67.75 1ftt h VAL 45 Cb 0.04 0.03 -0.02 0.00 -1.52 0.00 0.00 31.29 29.82 1ftt h VAL 45 CO -0.05 0.00 -0.08 0.50 0.02 0.00 0.00 177.57 177.96 1ftt h LYS 46 N -0.58 0.58 0.16 1.57 3.11 -0.52 -0.44 116.57 120.46 1ftt h LYS 46 Ca 0.04 -0.16 -0.01 0.00 -2.81 0.00 0.00 60.65 57.71 1ftt h LYS 46 Cb 0.68 -0.07 0.00 0.00 -1.00 0.00 0.00 32.23 31.84 1ftt h LYS 46 CO -0.42 0.66 -0.08 0.82 -2.81 0.00 0.00 179.45 177.62 1ftt h ILE 47 N 0.54 0.85 -0.26 2.00 2.04 -0.82 0.28 117.51 122.14 1ftt h ILE 47 Ca 0.10 -0.02 0.05 0.00 1.00 0.00 0.00 64.86 66.00 1ftt h ILE 47 Cb 0.47 0.86 -0.05 0.00 -0.74 0.00 0.00 36.82 37.35 1ftt h ILE 47 CO 0.02 0.00 -0.07 -0.25 0.00 0.00 0.00 178.15 177.86 1ftt h TRP 48 N -0.22 -0.15 -0.54 1.37 7.01 -0.60 -0.81 115.95 122.02 1ftt h TRP 48 Ca -0.02 0.02 0.05 0.00 2.11 0.00 0.00 58.89 61.05 1ftt h TRP 48 Cb 0.17 0.11 -0.05 0.00 -2.10 0.00 0.00 29.16 27.29 1ftt h TRP 48 CO -0.07 -0.12 0.27 0.74 -2.79 0.00 0.00 178.44 176.48 1ftt h PHE 49 N -0.01 0.50 0.06 2.65 0.04 -0.93 -1.38 116.94 117.87 1ftt h PHE 49 Ca 0.13 0.02 0.02 0.00 2.80 0.00 0.00 57.97 60.94 1ftt h PHE 49 Cb 0.20 -0.14 -0.04 0.00 2.20 0.00 0.00 35.95 38.16 1ftt h PHE 49 CO -0.26 0.24 -0.27 0.37 -0.60 0.00 0.00 178.31 177.78 1ftt h GLN 50 N 0.52 -0.44 -0.99 1.51 -0.00 -0.45 -0.22 115.11 115.05 1ftt h GLN 50 Ca 0.24 0.03 0.04 0.00 -0.00 0.00 0.00 58.65 58.96 1ftt h GLN 50 Cb 0.15 0.10 -0.06 0.00 0.00 0.00 0.00 27.48 27.67 1ftt h GLN 50 CO -0.17 -0.29 0.64 -0.91 0.00 0.00 0.00 178.83 178.10 1ftt h ASN 51 N -0.45 1.06 0.13 -0.69 2.35 -0.60 0.22 115.58 117.60 1ftt h ASN 51 Ca 0.05 -0.01 -0.21 0.00 -0.55 0.00 0.00 56.30 55.58 1ftt h ASN 51 Cb 0.51 -0.24 0.02 0.00 0.05 0.00 0.00 38.32 38.67 1ftt h ASN 51 CO -0.20 0.71 -0.92 0.45 -1.65 0.00 0.00 177.43 175.83 1ftt h HIS 52 N 1.22 0.67 0.00 1.19 3.86 -1.10 -3.06 115.15 117.93 1ftt h HIS 52 Ca 0.40 -0.46 -0.07 0.00 -1.16 0.00 0.00 60.37 59.08 1ftt h HIS 52 Cb 0.05 -0.04 -0.01 0.00 1.06 0.00 0.00 27.41 28.47 1ftt h HIS 52 CO -0.00 1.34 -0.34 0.07 0.86 0.00 0.00 177.93 179.86 1ftt h ARG 53 N -0.18 0.00 -0.73 2.45 0.11 -0.87 -2.78 114.38 112.37 1ftt h ARG 53 Ca -0.15 0.00 -0.07 0.00 0.10 0.00 0.00 59.98 59.86 1ftt h ARG 53 Cb 1.69 0.00 -0.03 0.00 1.11 0.00 0.00 29.97 32.74 1ftt h ARG 53 CO 0.17 0.34 0.20 -0.92 0.10 0.00 0.00 179.97 179.86 1ftt h TYR 54 N 0.00 1.20 -0.38 4.08 3.20 -1.00 -0.04 116.97 124.03 1ftt h TYR 54 Ca -0.00 -0.13 0.01 0.00 3.14 0.00 0.00 58.73 61.74 1ftt h TYR 54 Cb 0.62 -0.34 -0.02 0.00 1.54 0.00 0.00 36.73 38.52 1ftt h TYR 54 CO 0.00 0.96 0.24 -0.22 -1.64 0.00 0.00 178.16 177.50 1ftt h LYS 55 N 1.10 0.48 -0.49 1.82 3.11 -1.39 -0.55 116.57 120.65 1ftt h LYS 55 Ca 0.23 -0.03 -0.13 0.00 -2.81 0.00 0.00 60.65 57.91 1ftt h LYS 55 Cb 0.35 -0.11 -0.01 0.00 -1.00 0.00 0.00 32.23 31.46 1ftt h LYS 55 CO -0.00 0.32 -0.21 0.52 -2.81 0.00 0.00 179.45 177.27 1ftt h MET 56 N 0.49 1.00 -0.17 1.90 2.86 -1.44 0.11 114.93 119.70 1ftt h MET 56 Ca 0.15 -0.42 0.00 0.00 -2.06 0.00 0.00 59.70 57.36 1ftt h MET 56 Cb -0.03 -0.04 -0.01 0.00 0.06 0.00 0.00 31.60 31.58 1ftt h MET 56 CO -0.05 1.10 0.11 -0.22 1.06 0.00 0.00 176.91 178.91 1ftt h LYS 57 N 0.87 0.22 -0.50 1.72 3.64 -0.72 -2.54 116.57 119.25 1ftt h LYS 57 Ca 0.11 -0.02 -0.04 0.00 -1.27 0.00 0.00 60.65 59.44 1ftt h LYS 57 Cb 0.79 -0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 32.54 1ftt h LYS 57 CO 0.07 0.16 0.16 -0.09 -2.27 0.00 0.00 179.45 177.48 1ftt h ARG 58 N 0.21 0.77 0.00 1.90 2.43 -1.09 -3.47 114.38 115.14 1ftt h ARG 58 Ca 0.06 -0.16 0.00 0.00 -0.81 0.00 0.00 59.98 59.07 1ftt h ARG 58 Cb -0.01 -0.11 0.00 0.00 -0.42 0.00 0.00 29.97 29.43 1ftt h ARG 58 CO -0.01 0.72 0.00 0.00 -1.51 0.00 0.00 179.97 179.17 1ftt n GLN 59 N -4.51 0.00 -1.43 0.20 -0.00 0.39 -4.92 117.38 107.11 1ftt n GLN 59 Ca 0.02 0.00 -0.29 0.00 -0.00 0.00 0.00 57.00 56.72 1ftt n GLN 59 Cb 0.19 0.00 0.13 0.00 -0.00 0.00 0.00 30.24 30.56 1ftt n GLN 59 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1ftt s ALA 60 N 0.00 1.70 -0.68 2.61 0.00 -1.26 -4.53 121.76 119.60 1ftt s ALA 60 Ca 0.00 -0.36 -0.05 0.00 0.00 0.00 0.00 51.96 51.54 1ftt s ALA 60 Cb 0.00 -3.09 0.01 0.00 0.00 0.00 0.00 23.12 20.04 1ftt s ALA 60 CO 0.00 -2.27 0.66 1.17 0.00 0.00 0.00 175.76 175.32 1ftt n LYS 61 N -3.78 -1.60 -1.81 0.00 3.00 -1.26 -4.81 118.16 107.89 1ftt n LYS 61 Ca 0.06 1.50 -0.31 0.00 -0.00 0.00 0.00 58.31 59.56 1ftt n LYS 61 Cb 0.58 -4.96 -0.04 0.00 0.00 0.00 0.00 35.03 30.60 1ftt n LYS 61 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.40 176.89 1ftt s ASP 62 N -2.83 4.74 0.61 3.14 1.11 -1.26 -4.97 116.67 117.20 1ftt s ASP 62 Ca 0.07 0.33 -0.18 0.00 0.18 0.00 0.00 52.55 52.95 1ftt s ASP 62 Cb -0.02 -2.53 -0.02 0.00 1.07 0.00 0.00 42.92 41.42 1ftt s ASP 62 CO 0.79 -2.87 1.16 -0.54 1.18 0.00 0.00 175.17 174.88 1ftt s LYS 63 N 7.75 2.94 0.29 8.23 1.02 -1.26 -4.93 119.74 133.77 1ftt s LYS 63 Ca 0.82 1.64 0.03 0.00 0.02 0.00 0.00 55.97 58.47 1ftt s LYS 63 Cb -0.13 -1.95 0.71 0.00 -0.52 0.00 0.00 37.83 35.94 1ftt s LYS 63 CO 0.16 -1.19 1.67 0.00 -0.92 0.00 0.00 175.35 175.07 1ftt h ALA 64 N 0.61 1.33 0.00 5.17 0.00 -2.00 -3.45 119.26 120.92 1ftt h ALA 64 Ca -0.49 0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.61 1ftt h ALA 64 Cb 1.27 0.24 0.00 0.00 0.00 0.00 0.00 17.79 19.30 1ftt h ALA 64 CO 0.55 -0.41 0.00 0.00 0.00 0.00 0.00 179.25 179.39 1ftt n ALA 65 N -2.60 0.00 -1.99 0.00 0.00 -1.26 -4.92 120.51 109.74 1ftt n ALA 65 Ca 0.21 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 53.24 1ftt n ALA 65 Cb 0.66 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 20.08 1ftt n ALA 65 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.50 176.36 1ftt s GLN 66 N 0.00 4.31 0.00 0.00 2.00 -1.26 -5.04 119.66 119.67 1ftt s GLN 66 Ca 0.00 2.18 0.00 0.00 -2.00 0.00 0.00 55.36 55.54 1ftt s GLN 66 Cb 0.00 -3.17 0.00 0.00 0.80 0.00 0.00 33.01 30.64 1ftt s GLN 66 CO 0.00 -0.40 0.00 1.04 -0.50 0.00 0.00 175.29 175.43